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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H31Cl2N3.3H3O4P
Molecular Weight 750.436
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of AMINOQUINOL TRIPHOSPHATE, (R)-

SMILES

OP(O)(O)=O.OP(O)(O)=O.OP(O)(O)=O.CCN(CC)CCC[C@@H](C)NC1=CC(\C=C\C2=C(Cl)C=CC=C2)=NC3=CC(Cl)=CC=C13

InChI

InChIKey=NHNXMYYNFQHZMQ-CZNVFIAYSA-N
InChI=1S/C26H31Cl2N3.3H3O4P/c1-4-31(5-2)16-8-9-19(3)29-26-18-22(14-12-20-10-6-7-11-24(20)28)30-25-17-21(27)13-15-23(25)26;3*1-5(2,3)4/h6-7,10-15,17-19H,4-5,8-9,16H2,1-3H3,(H,29,30);3*(H3,1,2,3,4)/b14-12+;;;/t19-;;;/m1.../s1

HIDE SMILES / InChI

Molecular Formula C26H31Cl2N3
Molecular Weight 456.45
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Molecular Formula H3O4P
Molecular Weight 97.9952
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:41:24 GMT 2023
Edited
by admin
on Sat Dec 16 09:41:24 GMT 2023
Record UNII
M5WJ0JU91T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMINOQUINOL TRIPHOSPHATE, (R)-
Common Name English
1,4-PENTANEDIAMINE, N4-(7-CHLORO-2-(2-(2-CHLOROPHENYL)ETHENYL)-4-QUINOLINYL)-N1,N1-DIETHYL-, PHOSPHATE (1:3), (R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
91826861
Created by admin on Sat Dec 16 09:41:24 GMT 2023 , Edited by admin on Sat Dec 16 09:41:24 GMT 2023
PRIMARY
FDA UNII
M5WJ0JU91T
Created by admin on Sat Dec 16 09:41:24 GMT 2023 , Edited by admin on Sat Dec 16 09:41:24 GMT 2023
PRIMARY
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